Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H17N5O9S2 |
| Molecular Weight | 535.507 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NC1=NC(=CS1)C(=N\O[C@H](C(O)=O)C2=CC=C(O)C(O)=C2)\C(=O)N[C@H]3[C@H]4SCC=C(N4C3=O)C(O)=O
InChI
InChIKey=ILZCDOYRDFDUPN-XUQRFURESA-N
InChI=1S/C20H17N5O9S2/c21-20-22-8(6-36-20)12(24-34-14(19(32)33)7-1-2-10(26)11(27)5-7)15(28)23-13-16(29)25-9(18(30)31)3-4-35-17(13)25/h1-3,5-6,13-14,17,26-27H,4H2,(H2,21,22)(H,23,28)(H,30,31)(H,32,33)/b24-12-/t13-,14+,17-/m1/s1
| Molecular Formula | C20H17N5O9S2 |
| Molecular Weight | 535.507 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:22:39 GMT 2025
by
admin
on
Mon Mar 31 19:22:39 GMT 2025
|
| Record UNII |
RTK13J4D2A
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
|
NCI_THESAURUS |
C357
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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100000081819
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY | |||
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117211-03-7
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY | |||
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6624
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY | |||
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DTXSID60151724
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY | |||
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9807169
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY | |||
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RTK13J4D2A
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY | |||
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C142373
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY | |||
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SUB07392MIG
Created by
admin on Mon Mar 31 19:22:39 GMT 2025 , Edited by admin on Mon Mar 31 19:22:39 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
SOLVATE->ANHYDROUS | |||
|
|
SALT/SOLVATE -> PARENT |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
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ACTIVE MOIETY |